CID 34660

29653-80-3

Structural Information

Molecular Formula

C₁₆H₂₀N₂

SMILES

CN(C)CCN(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C16H20N2/c1-17(2)13-14-18(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12H,13-14H2,1-2H3

InChIKey

BVSCXLNOACOCHU-UHFFFAOYSA-N

Compound name

N,N-dimethyl-N',N'-diphenylethane-1,2-diamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 240.16264 Da
Monoisotopic Mass: 3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	241.169916	157.2
[M+Na]+	263.151858	161.5
[M-H]-	239.155364	165.9
[M+NH4]+	258.196463	174.9
[M+K]+	279.125798	159.7
[M+H-H2O]+	223.159900	148.4
[M+HCOO]-	285.160841	183.9
[M+CH3COO]-	299.176491	204.7
[M+Na-2H]-	261.137306	163.4
[M]+	240.16209142	158.0
[M]-	240.16318858	158.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe